1-Benzenesulfonyl-5-fluoro-1H-pyrrolo[2,3-b]pyridine - CAS 1015608-79-3
Catalog: |
BB000535 |
Product Name: |
1-Benzenesulfonyl-5-fluoro-1H-pyrrolo[2,3-b]pyridine |
CAS: |
1015608-79-3 |
Synonyms: |
1-(benzenesulfonyl)-5-fluoropyrrolo[2,3-b]pyridine |
IUPAC Name: | 1-(benzenesulfonyl)-5-fluoropyrrolo[2,3-b]pyridine |
Description: | 1-Benzenesulfonyl-5-fluoro-1H-pyrrolo[2,3-b]pyridine (CAS# 1015608-79-3) is a useful research chemical. |
Molecular Weight: | 276.29 |
Molecular Formula: | C13H9FN2O2S |
Canonical SMILES: | C1=CC=C(C=C1)S(=O)(=O)N2C=CC3=CC(=CN=C32)F |
InChI: | InChI=1S/C13H9FN2O2S/c14-11-8-10-6-7-16(13(10)15-9-11)19(17,18)12-4-2-1-3-5-12/h1-9H |
InChI Key: | SBQNWSGBQDRMLK-UHFFFAOYSA-N |
Purity: | 95 % |
MDL: | MFCD08741536 |
LogP: | 3.49320 |
Publication Number | Title | Priority Date |
US-2019211011-A1 | Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases | 20160926 |
EP-3515912-B1 | Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases | 20160926 |
US-10906900-B2 | Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases | 20160926 |
CN-110036004-A | The inhibitor of cell cycle protein dependent kinase 7 (CDK7) | 20160713 |
EP-3484871-A1 | Inhibitors of cyclin-dependent kinase 7 (cdk7) | 20160713 |
Complexity: | 417 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 276.03687687 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 276.03687687 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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